0 mol 34 unq 0 iso 0 dist 9.52614 8.82122 11.3602 9.45239 5.74823 13.2482 numMergedOcc 0
1 mol 48 unq 0 iso 0 dist 8.96621 9.18584 14.1218 8.94842 8.27973 14.0934 numMergedOcc 0
2 mol 48 unq 1 iso 0 dist 8.96621 9.18584 14.1218 9.9555 10.6228 16.3517 numMergedOcc 0
3 mol 90 unq 0 iso 0 dist 9.46251 9.05357 9.05397 8.48639 11.7023 9.90294 numMergedOcc 0
4 mol 112 unq 0 iso 0 dist 9.45513 7.12413 8.70531 6.88696 4.74565 4.22481 numMergedOcc 0
5 mol 143 unq 0 iso 0 dist 8.99696 5.90772 5.12098 5.44814 7.51335 5.43382 numMergedOcc 0
6 mol 178 unq 0 iso 0 dist 5.71438 8.3134 11.5789 9.26238 12.035 6.05921 numMergedOcc 0
7 mol 178 unq 1 iso 0 dist 7.69328 5.20764 11.5789 7.97 12.0486 5.5646 numMergedOcc 0
8 mol 178 unq 2 iso 0 dist 7.69328 5.20764 11.5789 6.95432 13.4282 5.88866 numMergedOcc 0
9 mol 178 unq 3 iso 0 dist 7.69328 5.20764 11.5789 9.32853 12.035 6.05921 numMergedOcc 0
10 mol 223 unq 0 iso 0 dist 7.22882 9.67035 6.83716 5.50267 6.50937 6.59645 numMergedOcc 0
11 mol 224 unq 0 iso 0 dist 5.90784 6.4508 10.4999 8.96784 13.8957 4.38109 numMergedOcc 0
12 mol 224 unq 1 iso 0 dist 8.50322 6.4508 4.63666 8.96784 5.96427 4.38109 numMergedOcc 0
13 mol 257 unq 0 iso 0 dist 6.75578 9.46934 9.09314 5.81865 11.9011 10.0311 numMergedOcc 0
14 mol 257 unq 1 iso 0 dist 6.75578 9.48415 15.2738 5.81865 11.9011 5.65031 numMergedOcc 0
15 mol 257 unq 2 iso 0 dist 9.29499 9.46934 9.90571 5.81865 13.924 10.0311 numMergedOcc 0
16 mol 257 unq 3 iso 0 dist 9.29499 9.48415 15.3825 5.81865 13.924 5.65031 numMergedOcc 0
17 mol 260 unq 0 iso 0 dist 9.07261 7.469 9.25828 7.4261 13.8251 12.7207 numMergedOcc 0
18 mol 260 unq 1 iso 0 dist 9.07261 5.9721 10.1972 7.4261 13.8251 3.83954 numMergedOcc 0
19 mol 266 unq 0 iso 0 dist 9.12381 6.36049 5.34207 9.97206 14.5709 9.46948 numMergedOcc 0
20 mol 266 unq 1 iso 0 dist 9.12381 9.19928 11.2256 9.97206 14.5709 4.41057 numMergedOcc 0
21 mol 266 unq 2 iso 0 dist 8.79148 6.36049 5.04902 9.97206 13.1216 9.46948 numMergedOcc 0
22 mol 266 unq 3 iso 0 dist 8.79148 9.19928 11.3036 9.97206 13.1216 4.41057 numMergedOcc 0
23 mol 266 unq 4 iso 0 dist 8.14167 6.36049 13.2779 9.97206 11.0249 9.46948 numMergedOcc 0
24 mol 266 unq 5 iso 0 dist 8.14167 9.19928 13.3104 9.97206 11.0249 4.41057 numMergedOcc 0
25 mol 273 unq 0 iso 0 dist 7.70185 8.41674 8.84174 9.45329 16.117 10.9311 numMergedOcc 0
26 mol 273 unq 1 iso 0 dist 7.97117 6.8391 8.84174 5.63226 8.83577 10.0013 numMergedOcc 0
27 mol 273 unq 2 iso 0 dist 7.97117 6.06557 5.41741 5.63226 8.83577 4.42663 numMergedOcc 0
